N-(9,9-dimethyl-4,4a-dihydrofluoren-2-yl)-9,9-dimethylfluoren-2-amine

C30H29N — CID 167069130

IUPACN-(9,9-dimethyl-4,4a-dihydrofluoren-2-yl)-9,9-dimethylfluoren-2-amine
SMILESCC1(C)C2=CC(Nc3ccc4c(c3)C(C)(C)c3ccccc3-4)=CCC2c2ccccc21
InChIInChI=1S/C30H29N/c1-29(2)25-11-7-5-9-21(25)23-15-13-19(17-27(23)29)31-20-14-16-24-22-10-6-8-12-26(22)30(3,4)28(24)18-20/h5-15,17-18,24,31H,16H2,1-4H3
InChIKeyUMFRLLRRNVETPP-UHFFFAOYSA-N
MW403.57 g/mol
LogP7.69
Rot. Bonds2

About N-(9,9-dimethyl-4,4a-dihydrofluoren-2-yl)-9,9-dimethylfluoren-2-amine

N-(9,9-dimethyl-4,4a-dihydrofluoren-2-yl)-9,9-dimethylfluoren-2-amine (PubChem CID 167069130) has the molecular formula C30H29N and a molecular weight of 403.57 g/mol. Its IUPAC name is N-(9,9-dimethyl-4,4a-dihydrofluoren-2-yl)-9,9-dimethylfluoren-2-amine.

Molecular Properties

Compound NameN-(9,9-dimethyl-4,4a-dihydrofluoren-2-yl)-9,9-dimethylfluoren-2-amine
PubChem CID167069130
Molecular FormulaC30H29N
Molecular Weight403.57 g/mol
Exact Mass403.23
IUPAC NameN-(9,9-dimethyl-4,4a-dihydrofluoren-2-yl)-9,9-dimethylfluoren-2-amine
SMILESCC1(C)C2=CC(Nc3ccc4c(c3)C(C)(C)c3ccccc3-4)=CCC2c2ccccc21
InChIInChI=1S/C30H29N/c1-29(2)25-11-7-5-9-21(25)23-15-13-19(17-27(23)29)31-20-14-16-24-22-10-6-8-12-26(22)30(3,4)28(24)18-20/h5-15,17-18,24,31H,16H2,1-4H3
InChIKeyUMFRLLRRNVETPP-UHFFFAOYSA-N
XLogP7.69
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500403.57
LogP ≤ 57.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(9,9-dimethylfluoren-2-yl)-9,9,10,10-tetramethylanthracen-2-amine
CID 166647046
4-(9,9-dimethyl-4,4a-dihydrofluoren-2-yl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]aniline
CID 138529075
9,9-dimethyl-N-naphthalen-2-ylfluoren-2-amine
CID 58453890
N-[4-(9,9-dimethyl-4,4a-dihydrofluoren-4-yl)phenyl]-9,9-dimethylfluoren-2-amine
CID 163289523
N-[2-(2-cyclobutylphenyl)phenyl]-9,9-dimethylfluoren-2-amine
CID 177124830
N-(9,9-dimethyl-2,3-dihydrofluoren-3-yl)-9,9-dimethylfluoren-2-amine
CID 142508992
9,9-dimethyl-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]fluoren-2-amine
CID 134528915
N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 160556555
9,9-dimethyl-N-(4-trimethylsilylphenyl)fluoren-2-amine
CID 123399255
N-(4-ethenylphenyl)-9,9-dimethylfluoren-2-amine
CID 163509163
9,9-dimethyl-N-[4-[4-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]phenyl]fluoren-2-amine
CID 177113997
9,9-dimethyl-N-[4-(3-phenylphenyl)phenyl]fluoren-2-amine
CID 59357506

Frequently Asked Questions

What is the IUPAC name of N-(9,9-dimethyl-4,4a-dihydrofluoren-2-yl)-9,9-dimethylfluoren-2-amine?
The IUPAC name of N-(9,9-dimethyl-4,4a-dihydrofluoren-2-yl)-9,9-dimethylfluoren-2-amine (CID 167069130) is N-(9,9-dimethyl-4,4a-dihydrofluoren-2-yl)-9,9-dimethylfluoren-2-amine.
What is the SMILES notation for N-(9,9-dimethyl-4,4a-dihydrofluoren-2-yl)-9,9-dimethylfluoren-2-amine?
The canonical SMILES for N-(9,9-dimethyl-4,4a-dihydrofluoren-2-yl)-9,9-dimethylfluoren-2-amine is CC1(C)C2=CC(Nc3ccc4c(c3)C(C)(C)c3ccccc3-4)=CCC2c2ccccc21.
What is the InChIKey of N-(9,9-dimethyl-4,4a-dihydrofluoren-2-yl)-9,9-dimethylfluoren-2-amine?
The InChIKey is UMFRLLRRNVETPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H29N/c1-29(2)25-11-7-5-9-21(25)23-15-13-19(17-27(23)29)31-20-14-16-24-22-10-6-8-12-26(22)30(3,4)28(24)18-20/h5-15,17-18,24,31H,16H2,1-4H3.
What are the key properties of N-(9,9-dimethyl-4,4a-dihydrofluoren-2-yl)-9,9-dimethylfluoren-2-amine?
N-(9,9-dimethyl-4,4a-dihydrofluoren-2-yl)-9,9-dimethylfluoren-2-amine has a molecular weight of 403.57 g/mol, XLogP of 7.69, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9,9-dimethyl-4,4a-dihydrofluoren-2-yl)-9,9-dimethylfluoren-2-amine is sourced from PubChem (CID 167069130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).